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100959-52-2 | 1H-Indazol-7-amine, 4-chloro-
CAS No: 100959-52-2 Catalog No: AG0003BU MDL No:MFCD09026964
Product Description
Catalog Number:
AG0003BU
Chemical Name:
1H-Indazol-7-amine, 4-chloro-
CAS Number:
100959-52-2
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD09026964
IUPAC Name:
4-chloro-1H-indazol-7-amine
InChI:
InChI=1S/C7H6ClN3/c8-5-1-2-6(9)7-4(5)3-10-11-7/h1-3H,9H2,(H,10,11)
InChI Key:
ZKJOFZAKOCJTDQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(c2c1cn[nH]2)N
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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